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35855448
35855448

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Popular Name: 6-(trifluoromethyl)-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione 6-(trifluoromethyl)-2,4-dihydro-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.60 3.98 -10.83 1 4 0 63 231.129 1 ↓

Analogs

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Popular Name: 1-(3-methoxypropyl)-3,1-benzoxazine-2,4-dione 1-(3-methoxypropyl)-3,1-benzoxaz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.05 5.71 -13.09 0 5 0 61 235.239 4 ↓

Analogs

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Popular Name: 1-(2-furylmethyl)-3,1-benzoxazine-2,4-dione 1-(2-furylmethyl)-3,1-benzoxazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.65 7.05 -12.63 0 5 0 65 243.218 2 ↓

Analogs

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Popular Name: 1-(2-methylallyl)-3,1-benzoxazine-2,4-dione 1-(2-methylallyl)-3,1-benzoxazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.99 7.07 -11.71 0 4 0 52 217.224 2 ↓

Analogs

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Popular Name: 1-[(E)-cinnamyl]-3,1-benzoxazine-2,4-dione 1-[(E)-cinnamyl]-3,1-benzoxazine…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.15 10.15 -13.31 0 4 0 52 279.295 3 ↓

Analogs

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Popular Name: 1-[(E)-but-2-enyl]-3,1-benzoxazine-2,4-dione 1-[(E)-but-2-enyl]-3,1-benzoxazi…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.70 7.28 -11.71 0 4 0 52 217.224 2 ↓

Analogs

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Popular Name: 1-[(3-chlorophenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(3-chlorophenyl)methyl]-3,1-b…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.05 9.31 -15.59 0 4 0 52 287.702 2 ↓

Analogs

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Popular Name: 1-[(5-bromo-2-fluoro-phenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(5-bromo-2-fluoro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.29 9.38 -14.62 0 4 0 52 350.143 2 ↓

Analogs

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Popular Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2-chloro-4-fluoro-phenyl)met…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.16 8.81 -9.84 0 4 0 52 305.692 2 ↓

Analogs

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Popular Name: 1-[(3-methoxyphenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(3-methoxyphenyl)methyl]-3,1-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.43 8.08 -12.75 0 5 0 61 283.283 3 ↓

Analogs

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Popular Name: 1-[(5-bromo-2-thienyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(5-bromo-2-thienyl)methyl]-3,…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.23 8.77 -11.36 0 4 0 52 338.182 2 ↓

Analogs

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Popular Name: 1-[(5-chloro-2-thienyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(5-chloro-2-thienyl)methyl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.10 8.67 -11.34 0 4 0 52 293.731 2 ↓

Analogs

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Popular Name: 1-[(5-ethyl-2-thienyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(5-ethyl-2-thienyl)methyl]-3,…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.09 9.52 -13.74 0 4 0 52 287.34 3 ↓

Analogs

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Popular Name: 1-[(2-bromophenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2-bromophenyl)methyl]-3,1-be…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.15 8.78 -9.68 0 4 0 52 332.153 2 ↓

Analogs

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Popular Name: 1-[(2-bromo-4-fluoro-phenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2-bromo-4-fluoro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.29 8.84 -9.79 0 4 0 52 350.143 2 ↓

Analogs

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Popular Name: 1-[(3-bromo-4-fluoro-phenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(3-bromo-4-fluoro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.29 9.46 -17.2 0 4 0 52 350.143 2 ↓

Analogs

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Popular Name: 1-[(2-bromo-5-fluoro-phenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2-bromo-5-fluoro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.29 8.84 -10.79 0 4 0 52 350.143 2 ↓

Analogs

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Popular Name: 1-(m-tolylmethyl)-3,1-benzoxazine-2,4-dione 1-(m-tolylmethyl)-3,1-benzoxazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.82 9.46 -13.36 0 4 0 52 267.284 2 ↓

Analogs

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Popular Name: 1-(o-tolylmethyl)-3,1-benzoxazine-2,4-dione 1-(o-tolylmethyl)-3,1-benzoxazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.80 9.97 -11.83 0 4 0 52 267.284 2 ↓

Analogs

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Popular Name: 1-[(4-bromo-2-fluoro-phenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(4-bromo-2-fluoro-phenyl)meth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.29 9.39 -17.83 0 4 0 52 350.143 2 ↓

Analogs

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Popular Name: 1-(2-ethoxyethyl)-3,1-benzoxazine-2,4-dione 1-(2-ethoxyethyl)-3,1-benzoxazin…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.16 6.25 -10.44 0 5 0 61 235.239 4 ↓

Analogs

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Popular Name: 1-(3-thienylmethyl)-3,1-benzoxazine-2,4-dione 1-(3-thienylmethyl)-3,1-benzoxaz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.98 7.76 -12.81 0 4 0 52 259.286 2 ↓

Analogs

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Popular Name: 1-[(2,3-difluorophenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2,3-difluorophenyl)methyl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.63 8.82 -22.26 0 4 0 52 289.237 2 ↓

Analogs

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Popular Name: 1-but-2-ynyl-3,1-benzoxazine-2,4-dione 1-but-2-ynyl-3,1-benzoxazine-2,4…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.77 7.38 -12.1 0 4 0 52 215.208 1 ↓

Analogs

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Popular Name: 1-(3-phenylprop-2-ynyl)-3,1-benzoxazine-2,4-dione 1-(3-phenylprop-2-ynyl)-3,1-benz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.62 10.41 -13.44 0 4 0 52 277.279 1 ↓

Analogs

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Popular Name: 1-[(2R)-2-methylpentyl]-3,1-benzoxazine-2,4-dione 1-[(2R)-2-methylpentyl]-3,1-benz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.98 8.53 -11.46 0 4 0 52 247.294 4 ↓

Analogs

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Popular Name: 1-[(2S)-2-methylpentyl]-3,1-benzoxazine-2,4-dione 1-[(2S)-2-methylpentyl]-3,1-benz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.98 8.67 -11.75 0 4 0 52 247.294 4 ↓

Analogs

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Popular Name: 1-[(1-methylpyrazol-4-yl)methyl]-3,1-benzoxazine-2,4-dione 1-[(1-methylpyrazol-4-yl)methyl]…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.77 6.54 -18.46 0 6 0 70 257.249 2 ↓

Analogs

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Popular Name: 1-[(1-ethylpyrazol-4-yl)methyl]-3,1-benzoxazine-2,4-dione 1-[(1-ethylpyrazol-4-yl)methyl]-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.15 7.4 -18.32 0 6 0 70 271.276 3 ↓

Analogs

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Popular Name: 1-[(2,4-difluorophenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2,4-difluorophenyl)methyl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.65 8.83 -18.58 0 4 0 52 289.237 2 ↓

Analogs

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Popular Name: 1-[(2R)-2-methylbutyl]-3,1-benzoxazine-2,4-dione 1-[(2R)-2-methylbutyl]-3,1-benzo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.42 7.77 -11.55 0 4 0 52 233.267 3 ↓

Analogs

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Popular Name: 1-[(2S)-2-methylbutyl]-3,1-benzoxazine-2,4-dione 1-[(2S)-2-methylbutyl]-3,1-benzo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.42 7.93 -11.82 0 4 0 52 233.267 3 ↓

Analogs

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Popular Name: 1-[(1S)-1-methylallyl]-3,1-benzoxazine-2,4-dione 1-[(1S)-1-methylallyl]-3,1-benzo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.81 6.86 -12.24 0 4 0 52 217.224 2 ↓

Analogs

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Popular Name: 1-[(1R)-1-methylallyl]-3,1-benzoxazine-2,4-dione 1-[(1R)-1-methylallyl]-3,1-benzo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.81 6.87 -12.17 0 4 0 52 217.224 2 ↓

Analogs

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Popular Name: 1-(tetrahydropyran-4-ylmethyl)-3,1-benzoxazine-2,4-dione 1-(tetrahydropyran-4-ylmethyl)-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.56 6.61 -13.74 0 5 0 61 261.277 2 ↓

Analogs

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Popular Name: 1-(2-methylsulfonylethyl)-3,1-benzoxazine-2,4-dione 1-(2-methylsulfonylethyl)-3,1-be…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.20 3.41 -20.28 0 6 0 86 269.278 3 ↓

Analogs

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Popular Name: 1-[(3R)-1,1-dioxothiolan-3-yl]-3,1-benzoxazine-2,4-dione 1-[(3R)-1,1-dioxothiolan-3-yl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.32 3.57 -20.97 0 6 0 86 281.289 1 ↓

Analogs

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Popular Name: 1-[(3S)-1,1-dioxothiolan-3-yl]-3,1-benzoxazine-2,4-dione 1-[(3S)-1,1-dioxothiolan-3-yl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.32 3.58 -22.96 0 6 0 86 281.289 1 ↓

Analogs

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Popular Name: 1-(2-ethylsulfonylethyl)-3,1-benzoxazine-2,4-dione 1-(2-ethylsulfonylethyl)-3,1-ben…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.58 4.3 -19.65 0 6 0 86 283.305 4 ↓

Analogs

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Popular Name: 1-[(3,5-dimethylphenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(3,5-dimethylphenyl)methyl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.22 10.11 -13.5 0 4 0 52 281.311 2 ↓

Analogs

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Popular Name: 1-(cyclopentylmethyl)-3,1-benzoxazine-2,4-dione 1-(cyclopentylmethyl)-3,1-benzox…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.58 8.4 -11.91 0 4 0 52 245.278 2 ↓

Analogs

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Popular Name: 1-[(2,5-dimethylphenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2,5-dimethylphenyl)methyl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.22 10.67 -11.92 0 4 0 52 281.311 2 ↓

Analogs

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Popular Name: 1-[2-(2,2,2-trifluoroethoxy)ethyl]-3,1-benzoxazine-2,4-dione 1-[2-(2,2,2-trifluoroethoxy)ethy…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.71 6.89 -19.79 0 5 0 61 289.209 5 ↓

Analogs

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Popular Name: 1-(2-isopentyloxyethyl)-3,1-benzoxazine-2,4-dione 1-(2-isopentyloxyethyl)-3,1-benz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.44 8.35 -10.26 0 5 0 61 277.32 6 ↓

Analogs

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Popular Name: 1-[(4-bromo-2-thienyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(4-bromo-2-thienyl)methyl]-3,…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.03 8.66 -13.29 0 4 0 52 338.182 2 ↓

Analogs

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Popular Name: 1-[(2R)-2-ethylhexyl]-3,1-benzoxazine-2,4-dione 1-[(2R)-2-ethylhexyl]-3,1-benzox…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.99 9.9 -11.99 0 4 0 52 275.348 6 ↓

Analogs

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Popular Name: 1-[(2S)-2-ethylhexyl]-3,1-benzoxazine-2,4-dione 1-[(2S)-2-ethylhexyl]-3,1-benzox…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.99 10.18 -12.28 0 4 0 52 275.348 6 ↓

Analogs

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Popular Name: 1-[(2,5-difluorophenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(2,5-difluorophenyl)methyl]-3…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.65 8.83 -15.04 0 4 0 52 289.237 2 ↓

Analogs

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Popular Name: 1-[(4-ethylphenyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(4-ethylphenyl)methyl]-3,1-be…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.31 10.22 -13.44 0 4 0 52 281.311 3 ↓

Analogs

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Popular Name: 1-[(3-bromo-2-thienyl)methyl]-3,1-benzoxazine-2,4-dione 1-[(3-bromo-2-thienyl)methyl]-3,…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.03 8.38 -12.88 0 4 0 52 338.182 2 ↓

Parameters Provided:

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